N-(3-fluorophenyl)-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide

Systemtic Name: N-(3-fluorophenyl)-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-(3-fluorophenyl)-4-oxo-butanamide CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-N-(3-fluorophenyl)-4-oxobutanamide IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-(3-fluorophenyl)-4-oxobutanamide Traditional Name: 4-(4-besylpiperazino)-N-(3-fluorophenyl)-4-keto-butyramide Formula: C20H22FN3O4S MolecularWeight: 419.469783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)NC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)NC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22FN3O4S/c21-16-5-4-6-17(15-16)22-19(25)9-10-20(26)23-11-13-24(14-12-23)29(27,28)18-7-2-1-3-8-18/h1-8,15H,9-14H2,(H,22,25)